Citation: Hui-Juan LI, Zai-Gang LUO, Xiu-Xiu WANG. Crystal Structure and Thermal Property of 4-(3-Chlorophenyl)-3-isopropyl-1-methyl-3, 4-dihydroquinolin-2(1H)-one[J]. Chinese Journal of Structural Chemistry, ;2020, 39(5): 913-917. doi: 10.14102/j.cnki.0254-5861.2011-2565 shu

Crystal Structure and Thermal Property of 4-(3-Chlorophenyl)-3-isopropyl-1-methyl-3, 4-dihydroquinolin-2(1H)-one

Hui-Juan LI ^{a, b,,} ,
Zai-Gang LUO ^b,, ,
Xiu-Xiu WANG ^b

a.
Department of Pharmaceutical Engineering, Bengbu Medical College, Bengbu 233030, China
b.
College of Chemical Engineering, Anhui University of Science and Technology, Huainan 232001, China

Corresponding author: Hui-Juan LI, 18949670601@163.com Zai-Gang LUO, luozi139@163.com
Received Date: 7 August 2019
Accepted Date: 18 November 2019

Fund Project: the Natural Science Research Projects in Colleges and Universities of Anhui Province KJ2019A0116Natural Science Foundation of Anhui Province 1608085MB38

Figures(3)

The target compound (C₁₉H₂₀ClNO) was structurally determined by single-crystal X-ray diffraction. The crystal is in monoclinic system, space group P2₁/n with a = 9.2365(2), b = 12.1241(3), c = 14.9960(4) Å, β = 106.589(3)°, C₁₉H₂₀ClNO, M_r = 313.81, D_c = 1.295 g/cm³, V = 1609.42(7) Å³, Z = 4, F(000) = 664, µ(MoKa) = 2.097 mm^-1, T = 200(10) K, 2813 independent reflections with 2533 observed ones (I > 2σ(I)), R = 0.0389 and wR = 0.1057 with GOF = 1.043 (R = 0.0423 and wR = 0.1083 for all data). The 3, 4-dihydroquinolin-2(1H)-one moiety maintains thermodynamically stable trans configuration. The decomposition mechanism of compound 3 is complex by thermal analysis.
- 3,4-dihydroquinolin-2(1H)-one,
- crystal structure,
- thermal property
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